Information card for entry 4305259

Structure parameters

• Formula: H71 Hf Mo23 N6 O102.5 P2
• Calculated formula: Hf Mo23 N6 O102.5 P2
• Title of publication: Tetravalent Metal Complexation by Keggin and Lacunary Phosphomolybdate Anions
• Authors of publication: Roy Copping; Leif Jonasson; Andrew J. Gaunt; Dennis Drennan; David Collison; Madeleine Helliwell; Ross J. Pirttijarvi; Chris J. Jones; Anne Huguet; David C. Apperley; Nikolas Kaltsoyannis; Iain May
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5787 - 5798
• a: 13.3813 ± 0.0006 Å
• b: 37.905 ± 0.0011 Å
• c: 20.5948 ± 0.0008 Å
• α: 90°
• β: 114.223 ± 0.003°
• γ: 90°
• Cell volume: 9526.3 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0878
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.17
• Weighted residual factors for all reflections included in the refinement: 0.1784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No